N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide

C14H12Cl2N2O2 — CID 103763358

IUPACN-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide
SMILESCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cc[nH]c(=O)c1
InChIInChI=1S/C14H12Cl2N2O2/c1-18(8-9-2-3-11(15)12(16)6-9)14(20)10-4-5-17-13(19)7-10/h2-7H,8H2,1H3,(H,17,19)
InChIKeyGNVQVVMUCQQWQC-UHFFFAOYSA-N
MW311.17 g/mol
LogP2.95
Rot. Bonds3

About N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide

N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide (PubChem CID 103763358) has the molecular formula C14H12Cl2N2O2 and a molecular weight of 311.17 g/mol. Its IUPAC name is N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide
PubChem CID103763358
Molecular FormulaC14H12Cl2N2O2
Molecular Weight311.17 g/mol
Exact Mass310.03
IUPAC NameN-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide
SMILESCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cc[nH]c(=O)c1
InChIInChI=1S/C14H12Cl2N2O2/c1-18(8-9-2-3-11(15)12(16)6-9)14(20)10-4-5-17-13(19)7-10/h2-7H,8H2,1H3,(H,17,19)
InChIKeyGNVQVVMUCQQWQC-UHFFFAOYSA-N
XLogP2.95
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.17
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103762664
N-methyl-2-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide
CID 113257132
N-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide
CID 103763351
N-[(3,4-dichlorophenyl)methyl]-3-iodo-N-methylbenzamide
CID 60628796
3-amino-N-[(3,4-dichlorophenyl)methyl]-N,4-dimethylbenzamide
CID 60938287
N-[(4-bromophenyl)methyl]-3,4-dichloro-N-methylbenzamide
CID 60628401
N-(furan-2-ylmethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide
CID 103763376
5-chloro-N-[(3,4-dichlorophenyl)methyl]-N-methylfuran-2-carboxamide
CID 103601901
4-(carbamoylamino)-N-[(3,4-dichlorophenyl)methyl]-N-methylbenzamide
CID 26069791
N-[(3,4-dichlorophenyl)methyl]-3-(difluoromethoxy)-N-methylbenzamide
CID 112792497
N-methyl-N-[2-(methylamino)ethyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103885153
N-[(3,4-dichlorophenyl)methyl]-N,2-dimethylbenzamide
CID 112792499

Frequently Asked Questions

What is the IUPAC name of N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide (CID 103763358) is N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide is CN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cc[nH]c(=O)c1.
What is the InChIKey of N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide?
The InChIKey is GNVQVVMUCQQWQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O2/c1-18(8-9-2-3-11(15)12(16)6-9)14(20)10-4-5-17-13(19)7-10/h2-7H,8H2,1H3,(H,17,19).
What are the key properties of N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide?
N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide has a molecular weight of 311.17 g/mol, XLogP of 2.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 103763358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).